Entry |
|
Name |
Carprofen (USP/INN); Rimadyl (TN) |
Formula |
C15H12ClNO2
|
Exact mass |
273.0557
|
Mol weight |
273.7143
|
Structure |
|
Simcomp |
|
Class |
Anti-inflammatory
DG01504 Nonsteroidal anti-inflammatory drug (NSAID)
DG01908 Anti-inflammatory drug, propionic acid derivatives
|
Remark |
|
Efficacy |
Anti-inflammatory |
Comment |
veterinary (for oral use in dogs only)
|
Target |
|
Pathway |
ko00590 | Arachidonic acid metabolism |
|
Interaction |
|
Brite |
Drug groups [BR:br08330]
Anti-inflammatory
DG01504 Nonsteroidal anti-inflammatory drug (NSAID)
DG01908 Anti-inflammatory drug, propionic acid derivatives
D03410 Carprofen
Target-based classification of drugs [BR:br08310]
Enzymes
Oxidoreductases (EC1)
Prostaglandin synthase
PTGS1 (COX1)
D03410 Carprofen (USP/INN)
PTGS2 (COX2)
D03410 Carprofen (USP/INN)
|
Other DBs |
|
KCF data |
ATOM 19
1 C8y C 26.0690 -24.7872
2 C8y C 26.0690 -26.1386
3 C8y C 28.4096 -26.1386
4 C8y C 28.4096 -24.7872
5 N4x N 27.2392 -24.1115
6 C8x C 29.5799 -26.8142
7 C8x C 30.7502 -26.1386
8 C8y C 30.7502 -24.7872
9 C8x C 29.5799 -24.1115
10 C8x C 24.8987 -24.1115
11 C8x C 23.7283 -24.7872
12 C8y C 23.7283 -26.1386
13 C8x C 24.8987 -26.8142
14 C1c C 31.9015 -24.1115
15 C6a C 33.0719 -24.7872
16 O6a O 34.2422 -24.1115
17 C1a C 31.8967 -22.7602
18 O6a O 33.0719 -26.1384
19 X Cl 22.5295 -26.8304
BOND 21
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 1 5 1
6 3 6 1
7 6 7 2
8 7 8 1
9 8 9 2
10 4 9 1
11 1 10 2
12 10 11 1
13 11 12 2
14 12 13 1
15 13 2 2
16 8 14 1
17 14 15 1
18 15 16 1
19 14 17 1
20 15 18 2
21 12 19 1
|